SCHEMBL16482140

SCHEMBL16482140

c1ccc2c(c1)sc1c2ccc2c1c1cccc(-n3c4ccccc4c4ccccc43)c1n2-c1ccc(-n2c3ccccc3c3ccccc32)cc1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALOX5 P09917 1/20 0.33
TP53 P04637 1/20 0.32
ALDH1A1 P00352 1/20 0.31
GPR3 P46089 1/20 0.31
TNKS O95271 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30
MAPT P10636 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30
PRKDC P78527 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16482393 0.95 ATM (0.41) KDM4EATML3MBTL1ALOX5TP53
SCHEMBL16482334 0.93 TNKS (0.35) KDM4EATML3MBTL1ALOX5TP53
SCHEMBL16482193 0.92 ALOX5 (0.42) KDM4EATML3MBTL1ALOX5TNKS
SCHEMBL16482484 0.92 ALOX5 (0.33) ALOX5TP53TNKSTNKS2MAPT
SCHEMBL16482317 0.91 ALOX5 (0.35) KDM4EATML3MBTL1ALOX5TP53
SCHEMBL16482318 0.91 ALOX5 (0.33) ALOX5TP53ALDH1A1GPR3TNKS
SCHEMBL16482497 0.90 TNKS (0.36) KDM4EATML3MBTL1ALOX5TNKS
SCHEMBL16482494 0.90 TNKS (0.36) KDM4EATML3MBTL1ALOX5TNKS
SCHEMBL16544225 0.90 KDM4E (0.35) KDM4EATML3MBTL1TP53RXFP1
SCHEMBL16482487 0.88 TP53 (0.32) KDM4ETP53ALDH1A1MAPTRXFP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014057659-A1 COMPOUND, AND ORGANIC ELECTROLUMINESCENT ELEMENT PRODUCED USING SAME 出光興産株式会社 (JP) 2014-04-17 WO disclosed